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AMS-17

CAT: 0013-GTR19186818-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19186818-02Size:50 mg
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Description
AMS-17 is a potent and selective NLRP3 inflammasome inhibitor that suppresses microglial activation and reduces pro-inflammatory cytokine release in both cellular and animal models. This makes it a valuable research tool for studying neuroinflammation in disorders such as Alzheimer's disease, Parkinson's disease, and multiple sclerosis.
CAS Number
3019885-78-7
Field of Research
Immunology & Inflammation
Smiles
O=C1N (CCCN1S (=O) (C2=CC=C (C (F) (F) F) C=C2) =O) C3=CN=CN=C3
Molecular Formula
C15H13F3N4O3S
Molecular Weight
386.35
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

1-Pyrimidin-5-yl-3-[4-(trifluoromethyl)phenyl]sulfonyl-1,3-diazinan-2-one
CAS Number3019885-78-7
PubChem CID164516884
IUPAC Name1-pyrimidin-5-yl-3-[4-(trifluoromethyl)phenyl]sulfonyl-1,3-diazinan-2-one
Molecular FormulaC15H13F3N4O3S
Molecular Weight386.4
XLogP1.7
Topological Polar Surface Area91.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count8
Rotatable Bond Count3
Heavy Atom Count26
Formal Charge0
Complexity609
SMILES
C1CN(C(=O)N(C1)S(=O)(=O)C2=CC=C(C=C2)C(F)(F)F)C3=CN=CN=C3
InChI
InChI=1S/C15H13F3N4O3S/c16-15(17,18)11-2-4-13(5-3-11)26(24,25)22-7-1-6-21(14(22)23)12-8-19-10-20-9-12/h2-5,8-10H,1,6-7H2
InChIKey
SNZNLNYLUJNKLC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-Pyrimidin-5-yl-3-[4-(trifluoromethyl)phenyl]sulfonyl-1,3-diazinan-2-one
CAS: 3019885-78-7
CID: 164516884
Formula: C15H13F3N4O3S
MW: 386.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight386.4
XLogP31.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count8
Rotatable Bond Count3
Exact Mass386.06604595
Monoisotopic Mass386.06604595
Topological Polar Surface Area91.9 Ų
Heavy Atom Count26
Formal Charge0
Complexity609
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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